chempirical

Bisphenol C

C17H20O2CAS 79-97-0256.34 g/mol

Open in Covalent MOL file
OHHO
Phenol

Properties

Molecular formula
C17H20O2
Molar mass
256.34 g/mol
Exact mass
256.1463 Da
Melting point
136 °C
logP
4.04Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 51 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
79-97-0
SMILES
Cc1cc(C(C)(C)c2ccc(O)c(C)c2)ccc1O
InChIKey
YMTYZTXUZLQUSF-UHFFFAOYSA-N
InChI
InChI=1S/C17H20O2/c1-11-9-13(5-7-15(11)18)17(3,4)14-6-8-16(19)12(2)10-14/h5-10,18-19H,1-4H3

Weigh it out

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Names and synonyms

18 names · show all
  • Phenol, 4,4′-(1-methylethylidene)bis[2-methyl-
  • o-Cresol, 4,4′-isopropylidenedi-
  • 4,4′-(1-Methylethylidene)bis[2-methylphenol]
  • 4,4′-Isopropylidenedi-o-cresol
  • 2,2-Bis(4-hydroxy-3-methylphenyl)propane
  • Nonox DCP
  • 3,3′-Dimethyldian
  • 2,2-Bis(3-methyl-4-hydroxyphenyl)propane
  • 4,4′-Isopropylidenebis[2-methylphenol]
  • 4,4′-Dihydroxy-3,3′-dimethyldiphenyl-2,2-propane
  • Dicresylolpropane
  • 3,3′-Dimethylbisphenol A
  • Bis-o-cresol A
  • 3,3′-Dimethyl-4,4′-dihydroxydiphenyl-2,2-propane
  • 2,2′-Dimethyl-4,4′-isopropylidenebisphenol
  • 2,2′-(4-Hydroxy-3-methylphenyl)propane
  • NSC 408489
  • B 1567

Work with Bisphenol C

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-tert-Butyl-2-methylphenol98-27-171 % similar 2,2-Bis(3-amino-4-hydroxyphenyl)propane1220-78-658 % similar 4,4'-Isopropylidenedi-2,6-xylol5613-46-755 % similar Biscresolfluorene88938-12-954 % similar 2,4-Dicumylphenol2772-45-453 % similar 2,4-Dimethylphenol105-67-952 % similar Methylhydroquinone95-71-652 % similar O,O′-Diallylbisphenol A1745-89-749 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Methoxy-5-methyl-γ-phenylbenzenepropanol124937-73-1 4,4'-Methylenebis(2,6-dimethylphenol)5384-21-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook